SCHEMBL5757747

SCHEMBL5757747

FC(F)(F)c1ccc(-c2cn(Cc3ccc(Cl)c(Cl)c3)cn2)cc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PHF8 Q9UPP1 1/20 0.51
NPC1 O15118 2/20 0.50
RAB9A P51151 2/20 0.50
ALDH1A1 P00352 1/20 0.50
LMNA P02545 1/20 0.50
MAPT P10636 1/20 0.50
HTT P42858 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
NR1I3 Q14994 1/20 0.46
KCNH2 Q12809 2/20 0.43
CACNA1G O43497 1/20 0.43
KDM5B Q9UGL1 2/20 0.43
KDM4C Q9H3R0 1/20 0.42
CCR2 P41597 2/20 0.41
HPGDS O60760 1/20 0.41
CYP2E1 P05181 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2D6 P10635 1/20 0.40
CYP2A6 P11509 1/20 0.40

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL5756587 0.94 NPC1 (0.48) PHF8NPC1RAB9AALDH1A1LMNA
SCHEMBL5758470 0.88 NPC1 (0.53) PHF8NPC1RAB9AALDH1A1LMNA
SCHEMBL5755514 0.84 NPC1 (0.60) PHF8NPC1RAB9AALDH1A1LMNA
SCHEMBL5759382 0.82 HPGDS (0.59) PHF8NPC1RAB9AALDH1A1LMNA
SCHEMBL7151014 0.82 NPC1 (0.48) NPC1RAB9ALMNAHTTNR1I3
SCHEMBL5758218 0.80 KDM5B (0.48) PHF8NPC1RAB9AALDH1A1LMNA
SCHEMBL5760700 0.78 PHF8 (0.51) PHF8NPC1RAB9AALDH1A1LMNA
SCHEMBL5756087 0.77 KDM4C (0.47) PHF8KDM4CHPGDSCYP2E1CYP3A4
SCHEMBL14405161 0.76 CYP2E1 (0.50) NPC1RAB9AALDH1A1LMNAMAPT
SCHEMBL5410313 0.73 HPGDS (0.55) PHF8NPC1RAB9AALDH1A1LMNA

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1194144-B1 ANTIBACTERIAL COMPOUNDS AFFINIUM PHARM INC (CA) 2006-11-02 EP claimed
US-20030149089-A1 Antibacterial compounds SMITHKLINE BEECHAM CORPORATION 2003-08-07 US claimed
US-6559172-B1 Treatment of bacterial infections, particularly through the inhibition of FAB I. and antiobiotics SMITHKLINE BEECHAM CORPORATION 2003-05-06 US claimed
JP-2003500357-A 2003-01-07 JP claimed
EP-1194144-A4 ANTIBACTERIAL COMPOUNDS SMITHKLINE BEECHAM CORP (US) 2002-08-07 EP claimed
EP-1194144-A1 ANTIBACTERIAL COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 2002-04-10 EP claimed
WO-2000071120-A1 ANTIBACTERIAL COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 2000-11-30 WO claimed
EP-1194144-B1 ANTIBACTERIAL COMPOUNDS AFFINIUM PHARM INC (CA) 2006-11-02 EP disclosed
US-6673941-B2 Disubstituted imidazoles useful in the treatment of bacterial infections AFFINIUM PHARMACEUTICALS, INC. (CA) 2004-01-06 US disclosed
US-20030149089-A1 Antibacterial compounds SMITHKLINE BEECHAM CORPORATION 2003-08-07 US disclosed
US-6559172-B1 Treatment of bacterial infections, particularly through the inhibition of FAB I. and antiobiotics SMITHKLINE BEECHAM CORPORATION 2003-05-06 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20030149089-A1 Antibacterial compounds MRPL21, MRPS28, SPOUT1 PHF8 4427/4885NPC1 103/4885RAB9A 140/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.